methyl 4-azanyl-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: methyl 4-azanyl-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: methyl 4-amino-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 4-amino-5-cyano-2-(4-methoxyphenyl)-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 4-amino-5-cyano-2-(4-methoxyphenyl)pyrazole-3-carboxylic acid methyl ester Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C(=N2)C#N)N)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C(=N2)C#N)N)C(=O)OC

InChI

InChI=1S/C13H12N4O3/c1-19-9-5-3-8(4-6-9)17-12(13(18)20-2)11(15)10(7-14)16-17/h3-6H,15H2,1-2H3